Dear Andrew,
I have the same performance on the future in coming EEM implementation a win of
15-20% of time!!!
Guillaume
Le 25.04.18 10:50, « Andrew Dalke » <da...@dalkescientific.com> a écrit :
On Apr 25, 2018, at 01:31, David Hall <li...@cowsandmilk.net> wrote:
> You need to turn off RDK_INSTALL_INTREE
Thanks! I've put that my build notes for the next time I compile RDKit.
BTW, a quick benchmark of the new release shows that it's almost 15% faster
at parsing SMILES strings than 2016.09.3
That is, parsing the SMILES strings from ChEBI went from 17.0 to 14.6
seconds.
Nice work!
Andrew
da...@dalkescientific.com
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